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English
Ethyl phenyl sulfone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
chemical formula
C₈H₁₀O₂S
0 references
canonical SMILES
CCS(=O)(=O)c1ccccc1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C8H10O2S/c1-2-11(9,10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
0 references
InChIKey
VBQUDDWATQWCPP-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
599-70-2
0 references
PubChem CID
69032
1 reference
matched by identifier from
InChIKey
InChIKey
VBQUDDWATQWCPP-UHFFFAOYSA-N
ChEBI ID
194780
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C8H10O2S/c1-2-11(9,10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
SureChEMBL ID
SCHEMBL180713
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VBQUDDWATQWCPP-UHFFFAOYSA-N
NMRShiftDB structure ID
20208613
1 reference
matched by identifier from
InChIKey
InChIKey
VBQUDDWATQWCPP-UHFFFAOYSA-N
EC number
209-972-2
0 references
ECHA Substance Infocard ID
100.009.067
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.009.067
retrieved
29 December 2019
title
(ethylsulphonyl)benzene
(English)
quotation
CAS no.: 599-70-2
(English)
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